ChemSpider 2D Image | 2-{(2S)-2-[(1R)-4-Methyl-3-cyclohexen-1-yl]propyl}cyclopentanone | C15H24O

2-{(2S)-2-[(1R)-4-Methyl-3-cyclohexen-1-yl]propyl}cyclopentanone

  • Molecular FormulaC15H24O
  • Average mass220.350 Da
  • Monoisotopic mass220.182709 Da
  • ChemSpider ID57609258

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-{(2S)-2-[(1R)-4-Methyl-3-cyclohexen-1-yl]propyl}cyclopentanon [German] [ACD/IUPAC Name]
2-{(2S)-2-[(1R)-4-Methyl-3-cyclohexen-1-yl]propyl}cyclopentanone [ACD/IUPAC Name]
2-{(2S)-2-[(1R)-4-Méthyl-3-cyclohexén-1-yl]propyl}cyclopentanone [French] [ACD/IUPAC Name]
Cyclopentanone, 2-[(2S)-2-[(1R)-4-methyl-3-cyclohexen-1-yl]propyl]- [ACD/Index Name]
1035968-04-7 [RN]
2-{2-[(1R)-4-methylcyclohex-3-en-1-yl]propyl}cyclopentan-1-one

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 318.2±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.0±3.0 kJ/mol
Flash Point: 132.3±14.2 °C
Index of Refraction: 1.492
Molar Refractivity: 67.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 918.75
ACD/KOC (pH 5.5): 4598.94
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 918.75
ACD/KOC (pH 7.4): 4598.94
Polar Surface Area: 17 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 33.2±3.0 dyne/cm
Molar Volume: 231.1±3.0 cm3

Click to predict properties on the Chemicalize site


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